Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wb2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N ASP 1.A O no hydrogen 3.340 N/A ARG 4.A NH1 TYR 37.A O no hydrogen 2.745 N/A SER 5.A N ARG 36.A O no hydrogen 3.483 N/A SER 5.A OG ARG 100.A O no hydrogen 2.731 N/A THR 6.A N ARG 100.A O no hydrogen 2.970 N/A THR 6.A OG1 PHE 38.A O no hydrogen 3.427 N/A LEU 7.A N PHE 38.A O no hydrogen 2.704 N/A VAL 8.A N MET 103.A O no hydrogen 2.792 N/A HIS 9.A N ARG 40.A O no hydrogen 3.081 N/A TRP 10.A N THR 105.A O no hydrogen 2.824 N/A PHE 11.A N ILE 42.A O no hydrogen 2.837 N/A ARG 12.A NE GLU 107.A O no hydrogen 3.384 N/A ARG 12.A NH1 ASP 118.A OD1 no hydrogen 2.665 N/A ARG 12.A NH2 GLU 107.A O no hydrogen 3.442 N/A ARG 12.A NH2 ASP 118.A OD1 no hydrogen 3.023 N/A ARG 12.A NH2 ASP 118.A OD2 no hydrogen 2.437 N/A LYS 13.A NZ ASP 109.A OD1 no hydrogen 3.432 N/A LYS 13.A NZ GLU 111.A OE2 no hydrogen 2.796 N/A LYS 13.A NZ TYR 306.A OH no hydrogen 3.185 N/A GLY 14.A N PHE 266.A O no hydrogen 3.210 N/A LEU 15.A N PHE 266.A O no hydrogen 3.283 N/A ARG 16.A N GLY 14.A O no hydrogen 2.968 N/A ARG 16.A NE HIS 18.A O no hydrogen 3.114 N/A ARG 16.A NE ASP 19.A O no hydrogen 3.122 N/A ARG 16.A NH1 GLY 267.A O no hydrogen 2.920 N/A ARG 16.A NH2 ASP 19.A O no hydrogen 3.288 N/A ARG 16.A NH2 GLU 107.A OE2 no hydrogen 2.976 N/A ARG 16.A NH2 SER 137.A O no hydrogen 3.039 N/A LEU 17.A N GLU 223.A OE1 no hydrogen 2.920 N/A HIS 18.A N GLU 223.A OE2 no hydrogen 3.176 N/A HIS 18.A ND1 GLU 223.A OE2 no hydrogen 2.882 N/A ASP 19.A N GLY 175.A O no hydrogen 3.341 N/A ASN 20.A ND2 ARG 16.A O no hydrogen 3.194 N/A LEU 23.A N ASN 20.A OD1 no hydrogen 3.055 N/A SER 24.A N ASN 20.A O no hydrogen 2.810 N/A SER 24.A OG ASN 20.A O no hydrogen 3.539 N/A HIS 25.A N PRO 21.A O no hydrogen 2.969 N/A PHE 27.A N LEU 23.A O no hydrogen 3.409 N/A THR 28.A N SER 24.A O no hydrogen 2.864 N/A THR 28.A OG1 SER 24.A O no hydrogen 2.693 N/A THR 28.A OG1 HIS 25.A O no hydrogen 3.081 N/A ALA 29.A N HIS 25.A O no hydrogen 2.947 N/A ALA 30.A N ILE 26.A O no hydrogen 2.772 N/A ASN 31.A N PHE 27.A O no hydrogen 3.436 N/A ASN 31.A ND2 LYS 179.A O no hydrogen 3.330 N/A ALA 32.A N THR 28.A O no hydrogen 3.031 N/A ALA 33.A N ALA 29.A O no hydrogen 3.255 N/A TYR 37.A OH GLU 102.A OE2 no hydrogen 3.262 N/A PHE 38.A N SER 5.A O no hydrogen 2.676 N/A ARG 40.A N LEU 7.A O no hydrogen 3.027 N/A ARG 40.A NH1 GLU 192.A OE1 no hydrogen 3.386 N/A ARG 40.A NH1 GLU 192.A OE2 no hydrogen 3.133 N/A ARG 40.A NH2 GLU 192.A OE1 no hydrogen 3.209 N/A ILE 42.A N HIS 9.A O no hydrogen 2.789 N/A PHE 43.A N PHE 82.A O no hydrogen 2.871 N/A LEU 45.A N VAL 84.A O no hydrogen 2.802 N/A ILE 49.A N ASP 46.A O no hydrogen 3.353 N/A LEU 50.A N PRO 47.A O no hydrogen 3.125 N/A TRP 52.A N ILE 49.A O no hydrogen 2.600 N/A ASN 58.A ND2 GLN 358.A O no hydrogen 3.144 N/A ARG 59.A NH1 GLU 391.A O no hydrogen 2.651 N/A ARG 59.A NH1 GLN 392.A O no hydrogen 3.511 N/A ARG 59.A NH1 LEU 394.A O no hydrogen 2.986 N/A ARG 59.A NH2 GLN 54.A O no hydrogen 2.692 N/A TRP 60.A N GLY 56.A O no hydrogen 3.080 N/A ARG 61.A N ALA 57.A O no hydrogen 3.111 N/A ARG 61.A NH1 GLY 215.A O no hydrogen 2.986 N/A ARG 61.A NH2 GLY 215.A O no hydrogen 2.704 N/A PHE 62.A N ASN 58.A O no hydrogen 3.096 N/A LEU 63.A N ARG 59.A O no hydrogen 2.983 N/A GLN 64.A N TRP 60.A O no hydrogen 2.930 N/A GLN 64.A NE2 GLU 68.A OE2 no hydrogen 2.924 N/A GLN 64.A NE2 PRO 202.A O no hydrogen 3.036 N/A GLN 65.A N ARG 61.A O no hydrogen 2.959 N/A THR 66.A N PHE 62.A O no hydrogen 2.925 N/A THR 66.A OG1 PHE 62.A O no hydrogen 2.685 N/A LEU 67.A N LEU 63.A O no hydrogen 2.922 N/A GLU 68.A N GLN 64.A O no hydrogen 3.213 N/A ASP 69.A N GLN 65.A O no hydrogen 3.151 N/A LEU 70.A N THR 66.A O no hydrogen 2.906 N/A ASP 71.A N LEU 67.A O no hydrogen 2.924 N/A ASN 72.A N GLU 68.A O no hydrogen 3.081 N/A GLN 73.A N ASP 69.A O no hydrogen 2.871 N/A GLN 73.A NE2 ASP 69.A OD1 no hydrogen 2.917 N/A LEU 74.A N LEU 70.A O no hydrogen 3.069 N/A ARG 75.A N ASP 71.A O no hydrogen 2.836 N/A ARG 75.A NH1 ASN 72.A OD1 no hydrogen 2.585 N/A ARG 75.A NH2 ASN 72.A OD1 no hydrogen 3.115 N/A LYS 76.A N GLN 73.A O no hydrogen 3.226 N/A LEU 77.A N LEU 74.A O no hydrogen 3.086 N/A ASN 78.A N ARG 75.A O no hydrogen 3.259 N/A ASN 78.A ND2 LEU 180.A O no hydrogen 2.776 N/A SER 79.A N LEU 74.A O no hydrogen 3.019 N/A SER 79.A OG ARG 80.A O no hydrogen 3.543 N/A ARG 80.A NE LEU 81.A O no hydrogen 2.825 N/A ARG 80.A NH1 ASP 200.A OD1 no hydrogen 3.553 N/A ARG 80.A NH2 LEU 81.A O no hydrogen 3.047 N/A ARG 80.A NH2 ASP 200.A OD1 no hydrogen 3.345 N/A LEU 81.A N ASP 71.A OD1 no hydrogen 2.792 N/A PHE 82.A N PRO 41.A O no hydrogen 2.963 N/A VAL 83.A N TYR 199.A O no hydrogen 2.882 N/A VAL 84.A N PHE 43.A O no hydrogen 2.881 N/A ARG 85.A NH1 VAL 83.A O no hydrogen 2.781 N/A ARG 85.A NH1 ASP 200.A O no hydrogen 2.754 N/A ARG 85.A NH2 ASP 200.A O no hydrogen 3.364 N/A GLY 86.A N LEU 45.A O no hydrogen 2.840 N/A GLU 90.A N LYS 87.A O no hydrogen 2.825 N/A VAL 91.A N PRO 88.A O no hydrogen 3.322 N/A PHE 92.A N PRO 88.A O no hydrogen 2.999 N/A ILE 95.A N VAL 91.A O no hydrogen 2.921 N/A PHE 96.A N PHE 92.A O no hydrogen 3.075 N/A SER 98.A N ARG 94.A O no hydrogen 2.927 N/A SER 98.A OG ARG 94.A O no hydrogen 2.479 N/A TRP 99.A N ILE 95.A O no hydrogen 2.860 N/A ARG 100.A NH1 SER 2.A O no hydrogen 2.628 N/A ARG 100.A NH2 GLN 3.A O no hydrogen 3.082 N/A VAL 101.A N PHE 96.A O no hydrogen 3.097 N/A GLU 102.A N THR 6.A O no hydrogen 2.757 N/A LEU 104.A N ARG 131.A O no hydrogen 2.795 N/A THR 105.A N VAL 8.A O no hydrogen 2.870 N/A THR 105.A OG1 ALA 22.A O no hydrogen 3.046 N/A THR 108.A N HIS 135.A O no hydrogen 2.760 N/A THR 108.A OG1 HIS 135.A O no hydrogen 3.341 N/A GLU 111.A N ASP 109.A OD1 no hydrogen 3.432 N/A SER 114.A OG ASP 109.A O no hydrogen 2.972 N/A SER 114.A OG GLU 111.A O no hydrogen 2.356 N/A VAL 115.A N GLU 111.A O no hydrogen 2.818 N/A THR 116.A N PRO 112.A O no hydrogen 3.137 N/A THR 116.A OG1 PRO 112.A O no hydrogen 3.203 N/A THR 116.A OG1 TYR 113.A O no hydrogen 2.892 N/A ARG 117.A N TYR 113.A O no hydrogen 2.962 N/A ARG 117.A NE ASP 118.A OD1 no hydrogen 3.127 N/A ASP 118.A N SER 114.A O no hydrogen 2.853 N/A ALA 119.A N VAL 115.A O no hydrogen 3.065 N/A ALA 120.A N THR 116.A O no hydrogen 3.194 N/A VAL 121.A N ARG 117.A O no hydrogen 2.947 N/A GLN 122.A N ASP 118.A O no hydrogen 2.693 N/A LYS 123.A N ALA 119.A O no hydrogen 2.858 N/A LEU 124.A N ALA 120.A O no hydrogen 2.996 N/A ALA 125.A N VAL 121.A O no hydrogen 3.069 N/A LYS 126.A N GLN 122.A O no hydrogen 3.098 N/A ALA 127.A N LYS 123.A O no hydrogen 3.241 N/A GLU 128.A N LEU 124.A O no hydrogen 3.201 N/A VAL 130.A N ALA 125.A O no hydrogen 2.746 N/A ARG 131.A N GLU 102.A O no hydrogen 3.094 N/A GLU 133.A N LEU 104.A O no hydrogen 3.256 N/A HIS 135.A N PHE 106.A O no hydrogen 3.018 N/A SER 137.A OG GLU 107.A OE2 no hydrogen 2.483 N/A HIS 138.A NE2 TYR 306.A OH no hydrogen 2.735 N/A THR 139.A OG1 TYR 141.A O no hydrogen 3.216 N/A ILE 140.A N GLU 303.A OE2 no hydrogen 2.750 N/A TYR 141.A N GLU 303.A OE1 no hydrogen 3.025 N/A GLU 144.A N ASN 142.A OD1 no hydrogen 3.001 N/A VAL 146.A N ASN 142.A O no hydrogen 3.083 N/A ILE 147.A N PRO 143.A O no hydrogen 3.062 N/A ALA 148.A N GLU 144.A O no hydrogen 3.016 N/A LYS 149.A N LEU 145.A O no hydrogen 3.035 N/A ASN 150.A N VAL 146.A O no hydrogen 3.115 N/A ASN 150.A ND2 LYS 153.A O no hydrogen 3.354 N/A GLY 152.A N ILE 147.A O no hydrogen 2.795 N/A LYS 153.A N ASN 150.A O no hydrogen 3.363 N/A TYR 158.A OH GLY 297.A O no hydrogen 2.954 N/A PHE 161.A N THR 157.A O no hydrogen 3.023 N/A LEU 162.A N TYR 158.A O no hydrogen 3.031 N/A GLY 163.A N GLN 159.A O no hydrogen 3.208 N/A ILE 164.A N LYS 160.A O no hydrogen 3.113 N/A VAL 165.A N PHE 161.A O no hydrogen 2.979 N/A GLU 166.A N LEU 162.A O no hydrogen 3.064 N/A GLN 167.A NE2 GLY 163.A O no hydrogen 2.608 N/A LEU 168.A N VAL 165.A O no hydrogen 2.823 N/A LEU 174.A N ASP 19.A OD1 no hydrogen 2.741 N/A LYS 179.A NZ ASN 78.A OD1 no hydrogen 2.689 N/A LEU 180.A N LEU 77.A O no hydrogen 3.258 N/A THR 185.A OG1 PRO 186.A O no hydrogen 3.503 N/A ASP 189.A N GLU 192.A OE1 no hydrogen 2.849 N/A GLU 192.A N ASP 189.A OD1 no hydrogen 2.509 N/A GLN 193.A N ASP 189.A O no hydrogen 2.927 N/A GLN 193.A NE2 LYS 188.A O no hydrogen 3.051 N/A ASP 195.A N VAL 191.A O no hydrogen 3.196 N/A ALA 197.A N ASP 195.A OD1 no hydrogen 3.122 N/A ALA 198.A N ASP 195.A O no hydrogen 3.229 N/A TYR 199.A OH ASP 189.A OD2 no hydrogen 2.487 N/A ASP 200.A N ALA 197.A O no hydrogen 3.286 N/A CYS 201.A SG LEU 67.A O no hydrogen 3.708 N/A CYS 201.A SG ASP 71.A OD2 no hydrogen 3.902 N/A THR 203.A N GLN 206.A OE1 no hydrogen 3.047 N/A THR 203.A OG1 GLN 206.A OE1 no hydrogen 3.139 N/A GLN 206.A N THR 203.A O no hydrogen 3.073 N/A GLN 206.A N THR 203.A OG1 no hydrogen 3.333 N/A LEU 207.A N THR 203.A O no hydrogen 3.198 N/A LEU 207.A N MET 204.A O no hydrogen 3.244 N/A VAL 208.A N MET 204.A O no hydrogen 2.768 N/A LYS 209.A NZ LYS 205.A O no hydrogen 2.793 N/A LYS 209.A NZ GLN 206.A O no hydrogen 2.678 N/A GLU 212.A N GLU 212.A OE1 no hydrogen 2.992 N/A GLU 213.A N ARG 210.A O no hydrogen 3.179 N/A LEU 214.A N PRO 211.A O no hydrogen 3.052 N/A GLY 215.A N ASN 58.A OD1 no hydrogen 3.182 N/A ASN 217.A ND2 GLN 65.A OE1 no hydrogen 3.416 N/A LYS 218.A N PRO 216.A O no hydrogen 2.820 N/A LYS 218.A NZ GLU 359.A OE1 no hydrogen 3.277 N/A THR 224.A N ASP 69.A OD2 no hydrogen 2.791 N/A THR 224.A OG1 ASP 69.A OD1 no hydrogen 2.763 N/A THR 224.A OG1 ASP 69.A OD2 no hydrogen 3.082 N/A ALA 226.A N GLY 222.A O no hydrogen 3.190 N/A LEU 227.A N GLU 223.A O no hydrogen 2.851 N/A ARG 228.A N THR 224.A O no hydrogen 3.017 N/A ARG 228.A NE GLU 225.A OE1 no hydrogen 2.869 N/A ARG 228.A NE GLU 225.A OE2 no hydrogen 3.399 N/A ARG 228.A NH1 GLU 232.A OE1 no hydrogen 3.037 N/A ARG 228.A NH2 GLU 225.A OE2 no hydrogen 3.109 N/A ARG 229.A N GLU 225.A O no hydrogen 2.827 N/A ARG 229.A NE THR 258.A O no hydrogen 2.614 N/A ARG 229.A NH2 THR 258.A O no hydrogen 3.558 N/A MET 230.A N ALA 226.A O no hydrogen 2.801 N/A GLU 231.A N LEU 227.A O no hydrogen 2.930 N/A GLU 232.A N ARG 228.A O no hydrogen 3.238 N/A SER 233.A N ARG 229.A O no hydrogen 2.956 N/A SER 233.A OG ARG 229.A O no hydrogen 2.768 N/A LEU 234.A N MET 230.A O no hydrogen 2.906 N/A LEU 234.A N GLU 231.A O no hydrogen 3.291 N/A LYS 235.A N GLU 232.A O no hydrogen 3.369 N/A TRP 239.A N ASP 236.A OD1 no hydrogen 3.212 N/A VAL 240.A N ASP 236.A O no hydrogen 3.320 N/A ALA 241.A N GLU 237.A O no hydrogen 2.936 N/A ARG 242.A N ILE 238.A O no hydrogen 2.957 N/A PHE 243.A N VAL 240.A O no hydrogen 3.410 N/A LYS 245.A N VAL 293.A O no hydrogen 2.984 N/A LYS 245.A NZ GLN 298.A OE1 no hydrogen 2.968 N/A ASN 247.A N GLU 244.A O no hydrogen 2.972 N/A THR 248.A N LYS 245.A O no hydrogen 3.114 N/A THR 248.A OG1 LYS 245.A O no hydrogen 2.552 N/A THR 248.A OG1 HIS 363.A NE2 no hydrogen 2.888 N/A ASN 251.A ND2 GLY 428.A O no hydrogen 2.729 N/A SER 252.A OG ALA 249.A O no hydrogen 3.343 N/A SER 252.A OG GLU 254.A O no hydrogen 2.674 N/A SER 256.A OG ALA 249.A O no hydrogen 2.687 N/A SER 261.A OG ASP 396.A OD2 no hydrogen 2.747 N/A TYR 263.A OH PRO 220.A O no hydrogen 2.549 N/A LEU 264.A N LEU 260.A O no hydrogen 2.914 N/A LYS 265.A N SER 261.A O no hydrogen 2.753 N/A LYS 265.A NZ GLN 397.A O no hydrogen 2.575 N/A PHE 266.A N PRO 262.A O no hydrogen 3.096 N/A LEU 269.A N TYR 263.A O no hydrogen 3.031 N/A SER 270.A N HIS 18.A NE2 no hydrogen 3.127 N/A SER 270.A OG ASP 19.A OD2 no hydrogen 2.609 N/A ARG 272.A N SER 270.A OG no hydrogen 3.146 N/A ARG 272.A NE ASP 19.A OD2 no hydrogen 2.667 N/A ARG 272.A NH2 ASP 19.A OD1 no hydrogen 2.350 N/A ARG 272.A NH2 ASP 19.A OD2 no hydrogen 2.891 N/A LEU 273.A N SER 270.A OG no hydrogen 3.133 N/A PHE 274.A N SER 270.A O no hydrogen 3.111 N/A ASN 275.A N ALA 271.A O no hydrogen 3.121 N/A GLN 276.A N ARG 272.A O no hydrogen 2.908 N/A LYS 277.A N LEU 273.A O no hydrogen 2.930 N/A LYS 277.A NZ GLU 231.A OE2 no hydrogen 3.088 N/A LEU 278.A N PHE 274.A O no hydrogen 2.930 N/A LYS 279.A N ASN 275.A O no hydrogen 2.928 N/A GLU 280.A N GLN 276.A O no hydrogen 3.259 N/A ILE 281.A N LEU 278.A O no hydrogen 3.036 N/A ILE 282.A N LEU 278.A O no hydrogen 3.013 N/A LYS 283.A N LYS 279.A O no hydrogen 3.144 N/A ARG 284.A N ILE 281.A O no hydrogen 2.974 N/A ARG 284.A NE GLU 280.A O no hydrogen 2.920 N/A GLN 285.A N ILE 282.A O no hydrogen 3.101 N/A HIS 288.A ND1 SER 289.A O no hydrogen 3.038 N/A SER 289.A N ALA 241.A O no hydrogen 2.842 N/A SER 289.A OG ALA 241.A O no hydrogen 3.108 N/A SER 289.A OG PHE 243.A O no hydrogen 2.511 N/A SER 294.A N GLN 290.A O no hydrogen 2.997 N/A GLY 297.A N SER 294.A OG no hydrogen 3.090 N/A GLN 298.A N SER 294.A O no hydrogen 2.998 N/A GLN 298.A NE2 VAL 293.A O no hydrogen 3.204 N/A GLN 298.A NE2 SER 294.A O no hydrogen 2.990 N/A LEU 299.A N LEU 295.A O no hydrogen 3.411 N/A MET 300.A N ILE 296.A O no hydrogen 2.913 N/A TRP 301.A N GLY 297.A O no hydrogen 2.862 N/A ARG 302.A N GLN 298.A O no hydrogen 3.336 N/A ARG 302.A NH1 HIS 138.A O no hydrogen 3.312 N/A ARG 302.A NH2 HIS 138.A O no hydrogen 2.845 N/A ARG 302.A NH2 LEU 264.A O no hydrogen 3.442 N/A GLU 303.A N LEU 299.A O no hydrogen 3.234 N/A PHE 304.A N MET 300.A O no hydrogen 2.882 N/A TYR 305.A N TRP 301.A O no hydrogen 3.127 N/A TYR 306.A N ARG 302.A O no hydrogen 3.087 N/A TYR 306.A OH ASP 398.A OD2 no hydrogen 2.533 N/A THR 307.A N GLU 303.A O no hydrogen 2.993 N/A THR 307.A OG1 GLU 303.A O no hydrogen 2.905 N/A VAL 308.A N PHE 304.A O no hydrogen 3.079 N/A ALA 309.A N TYR 305.A O no hydrogen 3.018 N/A ALA 310.A N TYR 306.A O no hydrogen 3.225 N/A ALA 310.A N THR 307.A O no hydrogen 2.963 N/A GLU 312.A N ALA 309.A O no hydrogen 3.123 N/A ASN 314.A N GLU 312.A OE2 no hydrogen 3.114 N/A ASN 314.A ND2 GLY 320.A O no hydrogen 3.243 N/A ARG 317.A NH2 ASN 314.A OD1 no hydrogen 2.435 N/A MET 318.A N GLU 384.A OE2 no hydrogen 2.817 N/A ASN 321.A N MET 318.A O no hydrogen 3.307 N/A ASN 321.A ND2 ARG 317.A O no hydrogen 2.814 N/A VAL 322.A N GLU 312.A OE1 no hydrogen 2.903 N/A TYR 323.A OH VAL 308.A O no hydrogen 2.697 N/A CYS 324.A SG MET 325.A O no hydrogen 3.244 N/A MET 325.A N SER 412.A O no hydrogen 2.882 N/A GLN 326.A N ASN 500.A OD1 no hydrogen 2.813 N/A GLN 326.A NE2 MET 318.A O no hydrogen 3.078 N/A GLN 326.A NE2 CYS 324.A O no hydrogen 3.208 N/A TRP 329.A N ILE 327.A O no hydrogen 2.782 N/A GLN 330.A N TRP 380.A O no hydrogen 3.140 N/A LEU 336.A N HIS 332.A O no hydrogen 2.814 N/A GLU 337.A N PRO 333.A O no hydrogen 2.928 N/A ALA 338.A N ASP 334.A O no hydrogen 3.154 N/A TRP 339.A N HIS 335.A O no hydrogen 3.218 N/A TRP 339.A NE1 VAL 370.A O no hydrogen 2.967 N/A THR 340.A N LEU 336.A O no hydrogen 3.007 N/A THR 340.A OG1 LEU 336.A O no hydrogen 2.635 N/A HIS 341.A N GLU 337.A O no hydrogen 3.137 N/A HIS 341.A ND1 GLU 337.A O no hydrogen 3.306 N/A GLY 342.A N TRP 339.A O no hydrogen 3.393 N/A ARG 343.A N ALA 338.A O no hydrogen 2.747 N/A THR 344.A N ASP 350.A OD1 no hydrogen 2.767 N/A THR 344.A OG1 ASP 350.A OD1 no hydrogen 2.515 N/A GLY 345.A N ASP 350.A OD2 no hydrogen 3.115 N/A TYR 346.A N THR 344.A OG1 no hydrogen 3.079 N/A TYR 346.A OH VAL 480.A O no hydrogen 3.009 N/A ASP 350.A N TYR 346.A O no hydrogen 2.816 N/A ALA 351.A N PRO 347.A O no hydrogen 2.810 N/A ILE 352.A N PHE 348.A O no hydrogen 3.258 N/A MET 353.A N ILE 349.A O no hydrogen 3.015 N/A ARG 354.A N ASP 350.A O no hydrogen 2.979 N/A ARG 354.A NE GLY 342.A O no hydrogen 3.050 N/A ARG 354.A NH1 GLU 444.A OE1 no hydrogen 3.132 N/A ARG 354.A NH1 GLU 444.A OE2 no hydrogen 2.798 N/A ARG 354.A NH2 GLY 342.A O no hydrogen 2.734 N/A GLN 355.A N ALA 351.A O no hydrogen 3.027 N/A GLN 355.A NE2 GLU 359.A OE1 no hydrogen 3.466 N/A LEU 356.A N ILE 352.A O no hydrogen 2.999 N/A ARG 357.A N MET 353.A O no hydrogen 3.116 N/A ARG 357.A NH2 THR 340.A O no hydrogen 3.091 N/A GLN 358.A N ARG 354.A O no hydrogen 2.844 N/A GLU 359.A N GLN 355.A O no hydrogen 2.736 N/A GLY 360.A N LEU 356.A O no hydrogen 2.883 N/A HIS 363.A NE2 THR 248.A OG1 no hydrogen 2.888 N/A LEU 365.A N HIS 363.A ND1 no hydrogen 2.978 N/A ARG 367.A N HIS 363.A O no hydrogen 2.905 N/A ARG 367.A NE ILE 362.A O no hydrogen 3.007 N/A ARG 367.A NH1 ASP 396.A OD1 no hydrogen 3.226 N/A ARG 367.A NH2 ILE 362.A O no hydrogen 3.236 N/A ARG 367.A NH2 ASP 396.A OD2 no hydrogen 2.753 N/A HIS 368.A N HIS 364.A O no hydrogen 3.083 N/A HIS 368.A ND1 TYR 422.A OH no hydrogen 2.577 N/A HIS 368.A NE2 HIS 364.A NE2 no hydrogen 2.931 N/A ALA 369.A N LEU 365.A O no hydrogen 3.059 N/A VAL 370.A N ALA 366.A O no hydrogen 3.219 N/A ALA 371.A N ARG 367.A O no hydrogen 3.044 N/A CYS 372.A N HIS 368.A O no hydrogen 2.882 N/A PHE 373.A N ALA 369.A O no hydrogen 3.270 N/A LEU 374.A N VAL 370.A O no hydrogen 3.094 N/A THR 375.A N ALA 371.A O no hydrogen 2.954 N/A THR 375.A OG1 ALA 371.A O no hydrogen 2.694 N/A ARG 376.A N CYS 372.A O no hydrogen 3.237 N/A ARG 376.A NE LEU 409.A O no hydrogen 2.804 N/A ARG 376.A NH1 ARG 420.A O no hydrogen 2.764 N/A ARG 376.A NH2 ARG 420.A O no hydrogen 2.768 N/A GLY 377.A N CYS 372.A O no hydrogen 2.683 N/A ASP 378.A N PHE 373.A O no hydrogen 3.163 N/A LEU 379.A N PHE 373.A O no hydrogen 3.080 N/A TRP 380.A NE1 PRO 328.A O no hydrogen 2.921 N/A ILE 381.A N LEU 374.A O no hydrogen 2.841 N/A GLU 384.A N SER 382.A OG no hydrogen 3.398 N/A GLU 385.A N SER 382.A O no hydrogen 3.078 N/A GLN 387.A N TRP 383.A O no hydrogen 2.885 N/A ARG 388.A N GLU 384.A O no hydrogen 3.223 N/A VAL 389.A N GLU 385.A O no hydrogen 3.372 N/A PHE 390.A N GLY 386.A O no hydrogen 2.938 N/A GLU 391.A N GLN 387.A O no hydrogen 2.843 N/A GLN 392.A N ARG 388.A O no hydrogen 3.259 N/A GLN 392.A NE2 MET 53.A O no hydrogen 3.590 N/A LEU 393.A N VAL 389.A O no hydrogen 3.084 N/A LEU 394.A N PHE 390.A O no hydrogen 2.944 N/A LEU 395.A N GLY 360.A O no hydrogen 3.062 N/A LEU 401.A N ASP 398.A OD1 no hydrogen 3.116 N/A ASN 402.A N ASP 398.A O no hydrogen 2.713 N/A ASN 402.A ND2 GLN 387.A O no hydrogen 3.249 N/A ALA 403.A N TRP 399.A O no hydrogen 3.321 N/A GLY 404.A N ALA 400.A O no hydrogen 3.114 N/A ASN 405.A N LEU 401.A O no hydrogen 3.111 N/A TRP 406.A N ASN 402.A O no hydrogen 3.089 N/A TRP 406.A N ALA 403.A O no hydrogen 3.127 N/A MET 407.A N ALA 403.A O no hydrogen 3.068 N/A TRP 408.A N GLY 404.A O no hydrogen 3.239 N/A LEU 409.A N ASN 405.A O no hydrogen 3.189 N/A SER 410.A N TRP 406.A O no hydrogen 3.052 N/A SER 410.A OG TRP 406.A O no hydrogen 2.718 N/A SER 410.A OG MET 407.A O no hydrogen 2.820 N/A SER 410.A OG SER 412.A OG no hydrogen 2.872 N/A ALA 411.A N TRP 408.A O no hydrogen 3.182 N/A SER 412.A N MET 407.A O no hydrogen 2.747 N/A SER 412.A OG SER 410.A OG no hydrogen 2.872 N/A ALA 413.A N MET 407.A O no hydrogen 3.450 N/A TYR 418.A N HIS 416.A O no hydrogen 2.806 N/A ARG 420.A N GLN 417.A O no hydrogen 2.942 N/A VAL 425.A N SER 423.A OG no hydrogen 3.272 N/A ALA 426.A N SER 423.A OG no hydrogen 2.998 N/A PHE 427.A N SER 423.A O no hydrogen 2.864 N/A LYS 429.A NZ GLU 455.A OE1 no hydrogen 2.710 N/A THR 431.A OG1 ASN 251.A OD1 no hydrogen 2.795 N/A THR 431.A OG1 GLY 428.A O no hydrogen 3.461 N/A ASP 432.A N GLY 428.A O no hydrogen 3.152 N/A GLY 435.A N ASP 432.A O no hydrogen 3.126 N/A HIS 436.A N ASP 432.A OD1 no hydrogen 3.032 N/A TYR 437.A N ASP 432.A OD2 no hydrogen 2.967 N/A TYR 437.A OH GLN 355.A OE1 no hydrogen 2.464 N/A ARG 439.A N GLY 435.A O no hydrogen 2.954 N/A ARG 439.A NE GLN 434.A O no hydrogen 3.305 N/A ARG 439.A NH1 TYR 448.A O no hydrogen 3.099 N/A ARG 439.A NH2 TYR 448.A O no hydrogen 2.393 N/A LYS 440.A N HIS 436.A O no hydrogen 3.058 N/A TYR 441.A N TYR 437.A O no hydrogen 3.217 N/A TYR 441.A OH GLU 359.A OE2 no hydrogen 2.308 N/A VAL 442.A N ILE 438.A O no hydrogen 2.729 N/A LEU 445.A N VAL 442.A O no hydrogen 3.055 N/A SER 446.A N PRO 443.A O no hydrogen 3.088 N/A SER 446.A OG PRO 443.A O no hydrogen 2.745 N/A TYR 448.A N LEU 445.A O no hydrogen 3.213 N/A TYR 448.A OH CYS 469.A O no hydrogen 2.729 N/A CYS 452.A N PRO 449.A O no hydrogen 3.226 N/A ILE 453.A N PRO 449.A O no hydrogen 2.944 N/A TYR 454.A OH ASP 432.A O no hydrogen 2.657 N/A GLU 455.A N CYS 452.A O no hydrogen 2.989 N/A LYS 458.A N GLU 455.A O no hydrogen 2.930 N/A ALA 459.A N PRO 456.A O no hydrogen 2.970 N/A ASP 463.A N SER 460.A OG no hydrogen 3.170 N/A GLN 464.A N SER 460.A O no hydrogen 2.724 N/A GLN 464.A NE2 ALA 459.A O no hydrogen 3.357 N/A ARG 465.A N LEU 461.A O no hydrogen 3.028 N/A ALA 466.A N VAL 462.A O no hydrogen 3.165 N/A TYR 467.A N ASP 463.A O no hydrogen 2.917 N/A GLY 468.A N ARG 465.A O no hydrogen 2.621 N/A CYS 469.A N GLN 464.A O no hydrogen 3.279 N/A VAL 470.A N ASP 474.A OD2 no hydrogen 2.899 N/A LEU 471.A N GLN 464.A OE1 no hydrogen 3.182 N/A GLY 472.A N TYR 475.A O no hydrogen 2.708 N/A THR 473.A N VAL 470.A O no hydrogen 3.169 N/A ASP 474.A N VAL 470.A O no hydrogen 2.988 N/A ARG 478.A NH1 TYR 346.A OH no hydrogen 3.286 N/A ARG 478.A NH1 GLU 483.A OE2 no hydrogen 2.738 N/A ILE 479.A N THR 344.A O no hydrogen 2.922 N/A HIS 482.A N TYR 346.A OH no hydrogen 2.909 N/A HIS 482.A ND1 ASP 378.A OD1 no hydrogen 2.631 N/A VAL 485.A N LYS 481.A O no hydrogen 3.050 N/A HIS 486.A N HIS 482.A O no hydrogen 3.103 N/A HIS 486.A ND1 HIS 482.A O no hydrogen 2.943 N/A ASN 489.A N VAL 485.A O no hydrogen 2.757 N/A ASN 489.A ND2 ARG 376.A O no hydrogen 3.342 N/A ASN 489.A ND2 ASP 378.A O no hydrogen 2.929 N/A ILE 490.A N HIS 486.A O no hydrogen 2.902 N/A LYS 491.A N LYS 487.A O no hydrogen 3.256 N/A ARG 492.A N GLU 488.A O no hydrogen 3.224 N/A MET 493.A N ASN 489.A O no hydrogen 2.941 N/A MET 493.A N ILE 490.A O no hydrogen 3.080 N/A GLY 494.A N ILE 490.A O no hydrogen 3.129 N/A ALA 495.A N LYS 491.A O no hydrogen 2.959 N/A ALA 496.A N ARG 492.A O no hydrogen 3.173 N/A TYR 497.A N MET 493.A O no hydrogen 2.910 N/A TYR 497.A OH ALA 411.A O no hydrogen 2.734 N/A LYS 498.A N GLY 494.A O no hydrogen 3.132 N/A VAL 499.A N ALA 495.A O no hydrogen 3.206 N/A ASN 500.A N ALA 496.A O no hydrogen 3.149 N/A ASN 500.A ND2 GLN 326.A O no hydrogen 2.694 N/A ASN 500.A ND2 ALA 496.A O no hydrogen 2.667 N/A ARG 501.A N TYR 497.A O no hydrogen 3.067 N/A ARG 501.A N LYS 498.A O no hydrogen 2.954 N/A GLU 502.A N LYS 498.A O no hydrogen 3.048 N/A VAL 503.A N VAL 499.A O no hydrogen 3.224 N/A ARG 504.A N ASN 500.A O no hydrogen 3.113 N/A THR 505.A N ARG 501.A O no hydrogen 2.829 N/A THR 505.A OG1 ARG 501.A O no hydrogen 3.454 N/A THR 505.A OG1 GLU 502.A O no hydrogen 2.455 N/A GLY 506.A N GLU 502.A O no hydrogen 2.686 N/A LYS 507.A N VAL 503.A O no hydrogen 3.142 N/A GLU 508.A N ARG 504.A O no hydrogen 3.393 N/A